COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK013546
Chemical Name: (2E)-2-cyano-3-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)Oc1ccc(cn1)[N+](=O)[O-])/C(=O)NCC1CCCO1

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Molecular Weight: 394.39
Empirical Formula: C20H18N4O5

Physical State: Dry powder
Available Amount: 354 mg

Lipinsky:
logP: 1.106
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 3

     

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